4-[(3-azanyl-4-methyl-phenyl)carbonylamino]benzenesulfonic acid

Systemtic Name: 4-[(3-azanyl-4-methyl-phenyl)carbonylamino]benzenesulfonic acid Openeye Name: 4-[(3-amino-4-methyl-benzoyl)amino]benzenesulfonic acid CAS Name: 4-[[(3-amino-4-methylphenyl)-oxomethyl]amino]benzenesulfonic acid IUPAC Name: 4-[(3-amino-4-methylbenzoyl)amino]benzenesulfonic acid Traditional Name: 4-[(3-amino-4-methyl-benzoyl)amino]besylic acid Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)O)N

InChI

InChI=1S/C14H14N2O4S/c1-9-2-3-10(8-13(9)15)14(17)16-11-4-6-12(7-5-11)21(18,19)20/h2-8H,15H2,1H3,(H,16,17)(H,18,19,20)